N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: N-(5-cyclopropyl-2-phenyl-3-pyrazolyl)-2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-cyclopropyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C25H26N6OS MolecularWeight: 458.57854

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4CC4)CC5=CC=CC=C5

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H26N6OS/c1-2-30-23(15-18-9-5-3-6-10-18)27-28-25(30)33-17-24(32)26-22-16-21(19-13-14-19)29-31(22)20-11-7-4-8-12-20/h3-12,16,19H,2,13-15,17H2,1H3,(H,26,32)